#------------------------------------------
#
# peak 1
#
description	121523 to 132509 ms, PARAFAC2 model with 2 components- Peak 1
# mass spectrum (m/z - intensity)
50	0.000583734
51	0.00195894
52	0.000353428
53	0.00581577
54	0.00568728
55	0.0305958
57	0.0331691
58	0.0500628
59	0.0237199
60	0.0250073
61	0.0142072
62	0.0262148
63	0.0129884
64	0.00551102
65	0.000764096
66	0.000162826
67	0.008106
68	0.00239956
69	0.0101839
70	0.0171607
71	0.0428043
72	0.00188998
73	0.00180119
74	0.00316985
75	0.0176743
76	0.0232943
77	0.983415
78	0.06792
79	0.0409248
80	0.000270898
81	0.00348769
82	0.00506807
83	0.00645954
84	0.00676425
85	0.000877309
86	0.127396
87	0.00961092
88	0.000143133
89	0.000675231
90	0.000696074
91	0.000117366
92	0.00373637
93	5.27882e-005
94	0.00130707
95	3.73455e-005
96	0.000274066
97	8.82843e-006
98	0.00624096
99	0.000673056
100	0.00332356
101	0.00350584
102	5.32958e-006
103	1.18706e-005
104	1.04342e-005
105	3.30123e-006
106	5.77125e-006
111	5.47402e-006
115	5.50267e-005
116	1.80364e-006
117	3.2534e-007
119	6.93479e-006
121	6.77843e-006
122	6.64145e-006
127	2.01249e-006
128	6.68331e-006
129	2.79455e-006
132	6.89568e-007
133	1.43778e-005
135	5.26595e-005
137	4.43099e-006
138	1.79459e-005
139	3.99927e-006
141	1.97537e-006
151	2.13969e-005
154	2.3775e-006
163	2.21703e-005
168	1.14575e-005
169	1.52454e-006
172	9.94465e-007
174	8.46735e-007
177	4.15507e-006
179	8.3255e-007
185	1.10235e-006
186	5.72909e-005
187	4.43869e-006
189	2.35235e-006
191	1.31224e-005
193	1.72358e-005
203	1.65914e-005
205	1.02698e-006
207	0.00393291
208	0.000125848
209	3.55961e-005
212	1.3737e-006
215	3.22101e-006
218	5.85368e-005
219	9.1433e-005
220	0.00053736
221	1.83147e-005
222	3.0067e-005
232	4.40295e-006
235	1.91227e-005
248	3.65371e-005
250	5.05143e-005
252	1.43139e-005
262	1.02324e-005
263	6.85776e-006
274	2.91041e-006
281	4.26684e-005
295	3.51383e-007
304	1.94694e-006
352	4.88131e-006
355	1.31413e-006
367	2.09059e-005
369	3.03279e-008
406	5.75985e-006
432	7.54197e-006
434	1.8231e-005
435	5.24122e-006
446	5.67651e-005
447	1.28474e-008
458	4.57655e-006
497	2.91041e-006
521	6.76853e-006
# elution profile (minutes converted to milliseconds - intensity)
121523	36.4633
121866	36.4338
122210	40.7109
122553	50.194
122896	301.264
123240	1193.54
123583	2790.93
123926	3669.8
124270	3892.02
124613	3822.78
124956	3491.87
125300	3118.73
125643	2750.98
125986	2374.39
126330	2043.73
126673	1772.81
127016	1571.16
127359	1369.5
127703	1205.64
128046	1067.37
128389	947.007
128733	866.751
129076	790.456
129419	734.007
129763	678.765
130106	625.352
130449	577.755
130793	538.169
131136	493.093
131479	454.082
131823	411.802
132166	380.392
132509	376.131
#------------------------------------------
#
# peak 2
#
description	121523 to 132509 ms, PARAFAC2 model with 2 components- Peak 2
# mass spectrum (m/z - intensity)
50	0.00273434
51	0.0160561
52	0.00486308
53	0.0234556
54	0.0129419
55	0.225636
56	0.951059
57	0.176842
58	0.0782118
59	0.00889904
60	0.0337277
61	0.00115915
62	0.000139847
64	0.0117625
65	0.000914815
66	0.00191083
67	0.00786381
68	0.00412847
69	0.0146956
70	0.0164603
71	0.0300432
72	0.0190181
73	0.0324943
74	0.0160895
75	0.00820081
78	0.00530691
79	0.00295759
80	2.20561e-005
81	0.00498699
82	0.00279414
83	0.00355834
84	0.0077874
85	0.00274695
86	0.0297376
87	0.00280986
88	1.36203e-005
89	0.00121725
90	0.00518064
91	8.90227e-005
92	0.00107745
94	0.0021965
95	0.000448684
96	0.00125201
97	7.99147e-005
98	0.00485233
99	0.00182796
100	0.00790916
101	5.70775e-005
102	3.46822e-006
103	0.000151732
104	7.90867e-006
105	0.000245931
106	4.20988e-006
115	9.85362e-005
116	1.13621e-006
117	5.296e-005
118	6.0549e-007
119	1.65895e-005
121	1.01763e-005
122	3.67191e-005
123	2.14754e-005
127	2.24768e-006
130	0.000103241
131	0.000189877
132	0.000230508
133	5.98439e-005
135	0.000103589
138	9.11619e-007
141	9.58421e-007
147	0.0197867
148	0.00290418
149	0.000795356
150	4.0456e-006
165	2.04099e-006
169	1.68175e-006
170	2.49784e-006
172	5.94774e-007
174	9.99286e-005
177	2.12897e-005
179	3.30683e-005
185	4.81014e-007
186	5.93753e-007
187	4.95795e-006
189	1.81695e-006
191	4.16836e-005
205	1.32548e-006
206	1.08609e-006
207	0.00597521
208	0.000111442
209	2.30539e-005
212	1.53355e-006
215	4.215e-006
218	3.58474e-005
220	0.000277664
223	2.32075e-006
232	6.08516e-007
235	4.20515e-007
248	2.50081e-005
249	2.04078e-005
250	5.48153e-005
252	1.29644e-005
253	1.63434e-006
262	6.58559e-005
263	5.44068e-006
264	9.79977e-005
274	1.14393e-006
281	9.09267e-006
295	7.71808e-007
304	7.00334e-006
315	5.40056e-005
352	1.52429e-007
355	6.97402e-006
369	1.67294e-007
446	9.53035e-006
447	1.95152e-006
458	1.60945e-006
477	3.57805e-006
493	2.538e-005
497	1.14393e-006
# elution profile (minutes converted to milliseconds - intensity)
121523	502.483
121866	456.221
122210	427.557
122553	398.191
122896	371.449
123240	345.063
123583	311.147
123926	293.571
124270	303.424
124613	326.58
124956	360.61
125300	408.401
125643	402.489
125986	390.976
126330	369.247
126673	328.377
127016	269.823
127359	236.587
127703	206.904
128046	183.346
128389	169.332
128733	175.919
129076	216.791
129419	281.482
129763	345.775
130106	389.158
130449	390.055
130793	347.632
131136	290.114
131479	236.365
131823	205.541
132166	186.836
132509	174.787
